name Intraclash total energy Backbone Hbond Sidechain Hbond Van der Waals Electrostatics Solvation Polar Solvation Hydrophobic Van de Waals clashes entropy side chain entropy main chain sloop_entropy mloop_entropy cis_bond torsional clash backbone clash helix dipole water bridge disulfide electrostatic Kon partial covalent bonds PIN3_1ZX6-7_1.PDB 1.39629 -5.59000 -0.24000 -1.96000 -6.17000 0.09000 5.16000 -9.00000 1.44000 3.90000 1.62000 0.00000 0.00000 0.00000 0.06000 0.81000 0.00000 -0.56000 0.00000 0.07000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_2.PDB 1.26576 -6.18000 -0.23000 -1.94000 -6.19000 0.09000 4.98000 -9.19000 1.54000 3.91000 1.32000 0.00000 0.00000 0.00000 0.06000 0.70000 0.00000 -0.60000 0.00000 0.08000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_3.PDB 1.57941 -5.83000 -0.03000 -1.75000 -6.54000 0.11000 4.99000 -9.50000 1.63000 4.30000 1.28000 0.00000 0.00000 0.00000 0.07000 0.85000 0.00000 -0.48000 0.00000 0.10000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_4.PDB 1.61277 -5.56000 -0.20000 -1.92000 -6.03000 0.06000 5.09000 -8.85000 1.48000 3.73000 1.50000 0.00000 0.00000 0.00000 0.04000 0.70000 0.00000 -0.47000 0.00000 0.01000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_5.PDB 1.40963 -6.02000 -0.23000 -1.97000 -6.24000 0.04000 5.11000 -9.17000 1.33000 3.96000 1.69000 0.00000 0.00000 0.00000 0.08000 0.81000 0.00000 -0.63000 0.00000 0.02000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_6.PDB 1.76187 -7.10000 -0.02000 -1.76000 -6.96000 0.08000 4.98000 -10.36000 1.42000 4.60000 1.61000 0.00000 0.00000 0.00000 0.07000 0.78000 0.00000 -0.82000 0.00000 0.07000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_7.PDB 1.77926 -6.00000 -0.23000 -1.95000 -6.29000 -0.02000 5.30000 -9.12000 1.42000 3.90000 1.43000 0.00000 0.00000 0.00000 0.07000 0.86000 0.00000 -0.46000 0.00000 -0.06000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_8.PDB 1.79364 -6.44000 -0.24000 -1.97000 -6.63000 0.01000 5.41000 -9.56000 1.32000 4.28000 1.53000 0.00000 0.00000 0.00000 0.02000 0.88000 0.00000 -0.54000 0.00000 -0.05000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_9.PDB 1.20028 -5.06000 -0.22000 -1.94000 -5.92000 0.16000 4.90000 -8.67000 1.34000 3.75000 1.75000 0.00000 0.00000 0.00000 0.04000 0.69000 0.00000 -0.40000 0.00000 0.14000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_10.PDB 1.41593 -6.93000 -0.25000 -1.98000 -6.55000 0.01000 4.93000 -9.69000 1.55000 4.24000 1.33000 0.00000 0.00000 0.00000 0.06000 0.73000 0.00000 -0.57000 0.00000 -0.01000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_11.PDB 1.95977 -6.17000 -0.24000 -1.92000 -6.09000 -0.13000 4.99000 -9.03000 1.41000 3.92000 1.48000 0.00000 0.00000 0.00000 0.07000 0.73000 0.00000 -0.42000 0.00000 -0.20000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_12.PDB 1.44691 -6.49000 -0.96000 -2.61000 -6.74000 -0.01000 6.10000 -9.35000 1.65000 4.17000 1.85000 0.00000 0.00000 0.00000 0.07000 1.13000 0.00000 -0.71000 0.00000 0.04000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_13.PDB 1.85564 -7.26000 -0.24000 -1.97000 -6.48000 -0.19000 5.19000 -9.51000 1.23000 4.15000 1.45000 0.00000 0.00000 0.00000 0.04000 0.73000 0.00000 -0.67000 0.00000 -0.25000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_14.PDB 1.28015 -5.34000 -0.24000 -1.93000 -6.03000 0.14000 4.84000 -8.88000 1.61000 3.75000 1.72000 0.00000 0.00000 0.00000 0.06000 0.73000 0.00000 -0.51000 0.00000 0.12000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_15.PDB 1.25692 -6.08000 -0.21000 -1.88000 -6.32000 0.13000 5.06000 -9.25000 1.67000 3.87000 1.23000 0.00000 0.00000 0.00000 0.05000 0.73000 0.00000 -0.55000 0.00000 0.11000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_16.PDB 1.59644 -6.63000 -0.02000 -1.76000 -6.79000 0.14000 4.80000 -10.07000 1.33000 4.50000 1.67000 0.00000 0.00000 0.00000 0.06000 0.83000 0.00000 -0.61000 0.00000 0.12000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_17.PDB 1.66799 -5.86000 -0.23000 -1.92000 -5.94000 0.01000 4.91000 -8.75000 1.28000 3.78000 1.57000 0.00000 0.00000 0.00000 0.05000 0.71000 0.00000 -0.55000 0.00000 -0.07000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_18.PDB 1.57639 -5.57000 -0.24000 -1.97000 -6.04000 0.13000 5.11000 -8.83000 1.39000 3.79000 1.41000 0.00000 0.00000 0.00000 0.02000 0.72000 0.00000 -0.45000 0.00000 0.12000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_19.PDB 1.38519 -5.37000 -0.02000 -1.76000 -6.05000 0.07000 4.81000 -8.85000 1.45000 3.84000 1.69000 0.00000 0.00000 0.00000 0.07000 0.81000 0.00000 -0.68000 0.00000 0.06000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_20.PDB 1.50858 -4.72000 -0.02000 -1.74000 -5.78000 0.15000 4.60000 -8.53000 1.51000 3.77000 1.66000 0.00000 0.00000 0.00000 0.08000 0.65000 0.00000 -0.53000 0.00000 0.13000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_21.PDB 1.83284 -7.48000 -0.24000 -2.23000 -6.77000 -0.30000 5.48000 -9.81000 1.41000 4.27000 1.50000 0.00000 0.00000 0.00000 0.07000 0.79000 0.00000 -0.50000 0.00000 -0.35000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_22.PDB 1.20826 -6.10000 -0.21000 -1.93000 -6.40000 0.09000 5.14000 -9.27000 1.71000 4.02000 1.25000 0.00000 0.00000 0.00000 0.05000 0.80000 0.00000 -0.63000 0.00000 0.08000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_23.PDB 1.55069 -6.34000 -0.02000 -1.76000 -6.38000 0.09000 4.70000 -9.45000 1.52000 4.24000 1.32000 0.00000 0.00000 0.00000 0.05000 0.72000 0.00000 -0.73000 0.00000 0.07000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_24.PDB 1.28878 -6.32000 -0.20000 -1.93000 -6.64000 0.14000 5.34000 -9.53000 1.36000 4.18000 1.38000 0.00000 0.00000 0.00000 0.04000 0.86000 0.00000 -0.59000 0.00000 0.12000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_25.PDB 2.52809 -6.35000 -0.24000 -2.26000 -7.02000 0.06000 5.90000 -10.13000 1.25000 4.45000 2.19000 0.00000 0.00000 0.00000 0.07000 0.91000 0.00000 -0.61000 0.00000 -0.02000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_26.PDB 1.65470 -7.74000 -1.05000 -2.76000 -7.23000 0.01000 6.22000 -9.83000 1.50000 4.49000 1.36000 0.00000 0.00000 0.00000 0.12000 1.18000 0.00000 -0.62000 0.00000 0.05000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_27.PDB 1.57689 -5.41000 -0.23000 -1.94000 -5.96000 0.03000 4.92000 -8.75000 1.68000 3.66000 1.52000 0.00000 0.00000 0.00000 0.04000 0.72000 0.00000 -0.36000 0.00000 -0.03000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_28.PDB 1.35117 -5.83000 -0.22000 -1.93000 -6.16000 -0.45000 5.53000 -8.61000 1.44000 4.11000 1.58000 0.00000 0.00000 0.00000 0.05000 0.64000 0.00000 -0.81000 0.00000 -0.35000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_29.PDB 1.45098 -5.84000 -0.21000 -1.92000 -6.18000 0.03000 5.14000 -8.95000 1.50000 3.87000 1.46000 0.00000 0.00000 0.00000 0.04000 0.72000 0.00000 -0.60000 0.00000 -0.02000 0.00000 2.38000 64.00000 PIN3_1ZX6-7_30.PDB 1.80165 -6.56000 -0.23000 -1.96000 -6.40000 -0.22000 5.23000 -9.27000 1.54000 4.18000 1.52000 0.00000 0.00000 0.00000 0.03000 0.75000 0.00000 -0.69000 0.00000 -0.27000 0.00000 2.38000 64.00000